methyl 3-(4-acetyloxyphenyl)-2-[[4-[(Z)-C-methyl-N-oxidanyl-carbonimidoyl]phenyl]carbamoylamino]propanoate

Systemtic Name: methyl 3-(4-acetyloxyphenyl)-2-[[4-[(Z)-C-methyl-N-oxidanyl-carbonimidoyl]phenyl]carbamoylamino]propanoate Openeye Name: methyl 3-(4-acetoxyphenyl)-2-[[4-[(Z)-N-hydroxy-C-methyl-carbonimidoyl]phenyl]carbamoylamino]propanoate CAS Name: 3-(4-acetyloxyphenyl)-2-[[[4-[(1Z)-1-hydroxyiminoethyl]anilino]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-acetyloxyphenyl)-2-[[4-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl]carbamoylamino]propanoate Traditional Name: 2-[(4-acetohydroximoylphenyl)carbamoylamino]-3-(4-acetoxyphenyl)propionic acid methyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)C1=CC=C(C=C1)NC(=O)NC(CC2=CC=C(C=C2)OC(=O)C)C(=O)OC

Isomeric SMILES

C/C(=N/O)/C1=CC=C(C=C1)NC(=O)NC(CC2=CC=C(C=C2)OC(=O)C)C(=O)OC

InChI

InChI=1S/C21H23N3O6/c1-13(24-28)16-6-8-17(9-7-16)22-21(27)23-19(20(26)29-3)12-15-4-10-18(11-5-15)30-14(2)25/h4-11,19,28H,12H2,1-3H3,(H2,22,23,27)/b24-13-